Br2Cd4P6
MatHub3d-17294-Br2Cd4P6
| Property | Value |
|---|---|
| Space group | (15, "'C2/c'") |
| Magnetic | False |
| Band gap (PBE) (eV) | 1.10 |
| Total energy (eV) | -40.841 |
| Total energy / atom (eV) | -3.403 |
| a, b, c (Å): | 8.090 | 9.090 | 7.540 |
| α, β, γ(°): | 90.0 | 100.0 | 90.0 |
| a, b, c (Å): | 6.180 | 6.180 | 7.660 |
| α, β, γ(°): | 97.0 | 97.0 | 97.0 |
| n_type (eV): | -5.003 |
| p_type (eV): | -3.372 |
Br2Cd4P6
| Property | Value |
|---|---|
| Bulk-modulus | 57.359 GPa |
Br2Cd4P6
| Property | Value |
|---|---|
| Band gap | 1.10 eV |
| Band degeneracy(CBM) | 2.00 |
| Band degeneracy(VBM) | 2.00 |
n-type Seebeck coefficient (700K)
p-type Seebeck coefficient (700K)
n-type conductivity (700K)
p-type conductivity (700K)
n-type power factor (700K)
p-type power factor (700K)
| Eband_VBM | -5.0646 |
| Eband_CBM | -1.17746 |
| Property | Value |
|---|---|
| Source | icsd-100880-Br2Cd4P6 |